SCHEMBL29924535

SCHEMBL29924535

O=Cc1cc([N+](=O)[O-])ccc1O.[Zn]

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 1/20 0.96
POLB P06746 2/20 0.58
ALDH1A1 P00352 5/20 0.56
MAPT P10636 5/20 0.56
GAA P10253 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
GPR35 Q9HC97 2/20 0.56
HPGD P15428 2/20 0.56
MAPK1 P28482 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
THRB P10828 1/20 0.55
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
ALPG P10696 1/20 0.51
RECQL P46063 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL79298 0.98 ERN1 (1.00) ERN1POLBALDH1A1MAPTGAA
SCHEMBL30135697 0.98 ERN1 (1.00) ERN1POLBALDH1A1MAPTGAA
Potassium SCHEMBL30661193 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
SCHEMBL11417323 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
SCHEMBL29114876 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
SCHEMBL29114875 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
SCHEMBL30661195 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
SCHEMBL11417328 0.96 ERN1 (0.96) ERN1POLBALDH1A1MAPTGAA
Hydrazine SCHEMBL28550593 0.95 ERN1 (0.93) ERN1POLBALDH1A1MAPTGAA
Ethylene SCHEMBL28992810 0.95 ERN1 (0.93) ERN1POLBALDH1A1MAPTGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115216891-A Antibacterial polypropylene melt-blown cloth material and preparation process thereof 广东春夏新材料科技股份有限公司 2022-10-21 CN claimed